Vitas-M small molecule compound
methyl 4,5-dimethyl-2-{[{[3-(2-methyl-1H-imidazol-1-yl)propyl]amino}(oxo)acetyl]amino}thiophene-3-carboxylate
Catalog ID
STK781068
SMILES COC(=O)c1c(NC(=O)C(=O)NCCCn2ccnc2C)sc(c1C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C17H22N4O4S MW 378.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N4O4S/c1-10-11(2)26-16(13(10)17(24)25-4)20-15(23)14(22)19-6-5-8-21-9-7-18-12(21)3/h7,9H,5-6,8H2,1-4H3,(H,19,22)(H,20,23)InChIKey
KBKOVQSIVHMZBL-UHFFFAOYSA-NSynonyms
CC1=C(SC(=C1C(=O)OC)NC(=O)C(=O)NCCCN2C=CN=C2C)C
InChI=1SC17H22N4O4Sc11011(2)2616(13(10)17(24)254)2015(23)14(22)1965821971812(21)3h79H568H214H3(H1922)(H2023)
methyl45dimethyl2((((3(2methyl1Himidazol1yl)propyl)amino)(oxo)acetyl)amino)thiophene3carboxylate
METHYL45DIMETHYL2((2(3(2METHYLIMIDAZOL1YL)PROPYLAMINO)2OXOACETYL)AMINO)THIOPHENE3CARBOXYLATE
MFCD06014271
ZINC000004625117
ZINC04625117
ZINC4625117
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